Home Thiazoles 99988-74-6
99988-74-6,MFCD04969038
Catalog No.:AA003VFB

99988-74-6 | (5E)-5-(4-Hydroxy-3,5-dimethoxybenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one

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1g
95%
in stock  
$123.00   $86.00
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Technical Information
Catalog Number:
AA003VFB
Chemical Name:
(5E)-5-(4-Hydroxy-3,5-dimethoxybenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one
CAS Number:
99988-74-6
Molecular Formula:
C12H11NO4S2
Molecular Weight:
297.3500
MDL Number:
MFCD04969038
SMILES:
COc1cc(/C=C\2/SC(=NC2=O)S)cc(c1O)OC
NSC Number:
122480
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
399  
Covalently-Bonded Unit Count:
1  
Defined Bond Stereocenter Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Rotatable Bond Count:
3  
XLogP3:
2.4  

Literature
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SDS
Tags:99988-74-6 Molecular Formula|99988-74-6 MDL|99988-74-6 SMILES|99988-74-6 (5E)-5-(4-Hydroxy-3,5-dimethoxybenzylidene)-2-mercapto-1,3-thiazol-4(5h)-one